3-(benzotriazol-1-ylmethyl)-2H-phthalazine-1,4-dione

Systemtic Name: 3-(benzotriazol-1-ylmethyl)-2H-phthalazine-1,4-dione Openeye Name: 3-(benzotriazol-1-ylmethyl)-2H-phthalazine-1,4-dione CAS Name: 3-(1-benzotriazolylmethyl)-2H-phthalazine-1,4-dione IUPAC Name: 3-(benzotriazol-1-ylmethyl)-2H-phthalazine-1,4-dione Traditional Name: 3-(benzotriazol-1-ylmethyl)-2H-phthalazine-1,4-quinone Formula: C15H11N5O2 MolecularWeight: 293.28014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C15H11N5O2/c21-14-10-5-1-2-6-11(10)15(22)20(17-14)9-19-13-8-4-3-7-12(13)16-18-19/h1-8H,9H2,(H,17,21)